Vitas-M small molecule compound
3-(benzylsulfanyl)-11-(2-methylpropyl)-7,8,9,10-tetrahydro[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3-c]isoquinoline
Catalog ID
STK721362
SMILES CC(Cc1nc2sc3c(c2c2c1CCCC2)ncn1c3nnc1SCc1ccccc1)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C25H25N5S2 MW 459.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N5S2/c1-15(2)12-19-17-10-6-7-11-18(17)20-21-22(32-24(20)27-19)23-28-29-25(30(23)14-26-21)31-13-16-8-4-3-5-9-16/h3-5,8-9,14-15H,6-7,10-13H2,1-2H3InChIKey
JNEPRSRJWYVUQI-UHFFFAOYSA-NSynonyms
497231-27-33(benzylsulfanyl)11(2methylpropyl)78910tetrahydro(124)triazolo(4316)pyrimido(4545)thieno(23c)isoquinoline
3(benzylthio)11isobutyl78910tetrahydro(124)triazolo(4316)pyrimido(4545)thieno(23c)isoquinoline
497231273
CC(C)CC1=C2CCCCC2=C3C4=C(C5=NN=C(N5C=N4)SCC6=CC=CC=C6)SC3=N1
InChI=1SC25H25N5S2c115(2)12191710671118(17)202122(3224(20)2719)23282925(30(23)142621)3113168435916h35891415H671013H212H3
MFCD03300682
ZINC000009046566
ZINC09046566
ZINC9046566
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